N-(3-acetamidophenyl)-2-[3-(phenylmethyl)quinolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-acetamidophenyl)-2-[3-(phenylmethyl)quinolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(3-acetamidophenyl)-2-[(3-benzyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(3-acetamidophenyl)-2-[[3-(phenylmethyl)-2-quinolinyl]thio]acetamide IUPAC Name: N-(3-acetamidophenyl)-2-(3-benzylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(3-acetamidophenyl)-2-[(3-benzyl-2-quinolyl)thio]acetamide Formula: C26H23N3O2S MolecularWeight: 441.54472

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)NC(=O)CSC2=NC3=CC=CC=C3C=C2CC4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)NC(=O)CSC2=NC3=CC=CC=C3C=C2CC4=CC=CC=C4

InChI

InChI=1S/C26H23N3O2S/c1-18(30)27-22-11-7-12-23(16-22)28-25(31)17-32-26-21(14-19-8-3-2-4-9-19)15-20-10-5-6-13-24(20)29-26/h2-13,15-16H,14,17H2,1H3,(H,27,30)(H,28,31)